N-[(2S)-1-oxidanylidene-3-phenyl-1-(3-phenylpropylamino)propan-2-yl]-N'-phenylmethoxy-octanediamide

Systemtic Name: N-[(2S)-1-oxidanylidene-3-phenyl-1-(3-phenylpropylamino)propan-2-yl]-N'-phenylmethoxy-octanediamide Openeye Name: N-[(1S)-1-benzyl-2-oxo-2-(3-phenylpropylamino)ethyl]-N'-benzyloxy-octanediamide CAS Name: N-[(2S)-1-oxo-3-phenyl-1-(3-phenylpropylamino)propan-2-yl]-N'-phenylmethoxyoctanediamide IUPAC Name: N-[(2S)-1-oxo-3-phenyl-1-(3-phenylpropylamino)propan-2-yl]-N'-phenylmethoxyoctanediamide Traditional Name: N'-benzoxy-N-[(1S)-1-benzyl-2-keto-2-(3-phenylpropylamino)ethyl]suberamide Formula: C33H41N3O4 MolecularWeight: 543.69634

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCNC(=O)C(CC2=CC=CC=C2)NC(=O)CCCCCCC(=O)NOCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)CCCCCCC(=O)NOCC3=CC=CC=C3

InChI

InChI=1S/C33H41N3O4/c37-31(22-12-1-2-13-23-32(38)36-40-26-29-19-10-5-11-20-29)35-30(25-28-17-8-4-9-18-28)33(39)34-24-14-21-27-15-6-3-7-16-27/h3-11,15-20,30H,1-2,12-14,21-26H2,(H,34,39)(H,35,37)(H,36,38)/t30-/m0/s1